2-[2-(2-oxidanylidenechromen-3-yl)thiolan-1-ium-1-yl]ethanal bromide

Systemtic Name: 2-[2-(2-oxidanylidenechromen-3-yl)thiolan-1-ium-1-yl]ethanal bromide Openeye Name: 2-[2-(2-oxochromen-3-yl)tetrahydrothiophen-1-ium-1-yl]acetaldehyde bromide CAS Name: 2-[2-(2-oxo-1-benzopyran-3-yl)-1-thiolan-1-iumyl]acetaldehyde bromide IUPAC Name: 2-[2-(2-oxochromen-3-yl)thiolan-1-ium-1-yl]acetaldehyde bromide Traditional Name: 2-[2-(2-ketochromen-3-yl)tetrahydrothiophen-1-ium-1-yl]acetaldehyde bromide Formula: C15H15BrO3S MolecularWeight: 355.2468

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([S+](C1)CC=O)C2=CC3=CC=CC=C3OC2=O.[Br-]

Isomeric SMILES

C1CC([S+](C1)CC=O)C2=CC3=CC=CC=C3OC2=O.[Br-]

InChI

InChI=1S/C15H15O3S.BrH/c16-7-9-19-8-3-6-14(19)12-10-11-4-1-2-5-13(11)18-15(12)17;/h1-2,4-5,7,10,14H,3,6,8-9H2;1H/q+1;/p-1